2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol

C12H25NO2 — CID 106874602

IUPAC2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol
SMILESCCCNC1(CCO)CCCCC1OC
InChIInChI=1S/C12H25NO2/c1-3-9-13-12(8-10-14)7-5-4-6-11(12)15-2/h11,13-14H,3-10H2,1-2H3
InChIKeyGSOCAPACQPDBCP-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.70
Rot. Bonds6

About 2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol

2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol (PubChem CID 106874602) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol.

Molecular Properties

Compound Name2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol
PubChem CID106874602
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol
SMILESCCCNC1(CCO)CCCCC1OC
InChIInChI=1S/C12H25NO2/c1-3-9-13-12(8-10-14)7-5-4-6-11(12)15-2/h11,13-14H,3-10H2,1-2H3
InChIKeyGSOCAPACQPDBCP-UHFFFAOYSA-N
XLogP1.70
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-(2-cyclopropylethyl)-2-methoxycyclohexan-1-amine
CID 106872628
1-(aminomethyl)-2-methoxy-N-(2-methylprop-2-enyl)cyclohexan-1-amine
CID 106872782
[2-(2-propoxyethyl)-1-(propylamino)cyclopentyl]methanol
CID 79581095
trans-(1S,2R)-1-(3-hydroxypropyl)-2-methoxycyclohexan-1-ol
CID 98010257
2-[1-(2-aminopropan-2-yl)-2-methoxycyclohexyl]ethanol
CID 106874731
methyl 2-[2-phenyl-1-(propylamino)cyclohexyl]acetate
CID 105403784
2-methoxy-1-pentylcyclohexan-1-ol
CID 106873594
methyl 2-[2,3-dimethyl-1-(propylamino)cyclohexyl]acetate
CID 65236117
ethyl 2-[2-tert-butyl-1-(propylamino)cyclohexyl]acetate
CID 65235828
[2-(2-cyclohexylsulfanylethyl)-1-(propylamino)cyclopentyl]methanol
CID 79580959
[2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79570962
N-[1-(aminomethyl)-2-methoxycyclohexyl]aniline
CID 106872574

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol?
The IUPAC name of 2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol (CID 106874602) is 2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol.
What is the SMILES notation for 2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol?
The canonical SMILES for 2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol is CCCNC1(CCO)CCCCC1OC.
What is the InChIKey of 2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol?
The InChIKey is GSOCAPACQPDBCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-3-9-13-12(8-10-14)7-5-4-6-11(12)15-2/h11,13-14H,3-10H2,1-2H3.
What are the key properties of 2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol?
2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol has a molecular weight of 215.34 g/mol, XLogP of 1.70, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxy-1-(propylamino)cyclohexyl]ethanol is sourced from PubChem (CID 106874602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).